(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine

C15H24N2O — CID 105065687

IUPAC(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine
SMILESCCC1CCC(C(N)c2ccncc2OC)CC1
InChIInChI=1S/C15H24N2O/c1-3-11-4-6-12(7-5-11)15(16)13-8-9-17-10-14(13)18-2/h8-12,15H,3-7,16H2,1-2H3
InChIKeyORYDKKIUIUVVQT-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.31
Rot. Bonds4

About (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine

(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine (PubChem CID 105065687) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine
PubChem CID105065687
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine
SMILESCCC1CCC(C(N)c2ccncc2OC)CC1
InChIInChI=1S/C15H24N2O/c1-3-11-4-6-12(7-5-11)15(16)13-8-9-17-10-14(13)18-2/h8-12,15H,3-7,16H2,1-2H3
InChIKeyORYDKKIUIUVVQT-UHFFFAOYSA-N
XLogP3.31
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxy-4-pyridinyl)propan-1-amine
CID 105065142
[2-cyclobutyl-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105310161
(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114655202
3-cyclopropyl-1-(3-methoxy-4-pyridinyl)propan-1-ol
CID 105066324
(4-ethylcyclohexyl)-(2-methoxy-3,4-dimethylphenyl)methanamine
CID 103433606
(R)-cyclopropyl-(2-methoxyphenyl)methanamine
CID 45072420
(3-ethylcyclopentyl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708268
(3-methoxy-4-pyridinyl)-(2-phenylcyclopropyl)methanamine
CID 105066143
(2,5-dimethoxyphenyl)-(3-ethylcyclopentyl)methanamine
CID 65411014
N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine
CID 105065449
(4-ethylcyclohexyl)-(4-methyl-3-pyridinyl)methanol
CID 66273542
1-(3-methoxy-4-pyridinyl)-2-propoxyethanamine
CID 105065820

Frequently Asked Questions

What is the IUPAC name of (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine?
The IUPAC name of (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine (CID 105065687) is (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine.
What is the SMILES notation for (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine?
The canonical SMILES for (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine is CCC1CCC(C(N)c2ccncc2OC)CC1.
What is the InChIKey of (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine?
The InChIKey is ORYDKKIUIUVVQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-11-4-6-12(7-5-11)15(16)13-8-9-17-10-14(13)18-2/h8-12,15H,3-7,16H2,1-2H3.
What are the key properties of (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine?
(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine has a molecular weight of 248.37 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine is sourced from PubChem (CID 105065687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).